| SpectraBase Compound ID | 12XdVbRCj83 |
|---|---|
| InChI | InChI=1S/C9H12OS/c1-3-9(7(2)10)8-4-5-11-6-8/h4-6,9H,3H2,1-2H3 |
| InChIKey | LNLXPNFKJYHFJH-UHFFFAOYSA-N |
| Mol Weight | 168.25 g/mol |
| Molecular Formula | C9H12OS |
| Exact Mass | 168.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EaL4IPbHcjB |
|---|---|
| Name | 2-Pentanone, 3-(3-thienyl)- |
| Alternate Name(s) | 3-(3-Thienyl)-2-pentanone |
| CAS Registry Number | 65857-61-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12OS |
| InChI | InChI=1S/C9H12OS/c1-3-9(7(2)10)8-4-5-11-6-8/h4-6,9H,3H2,1-2H3 |
| InChIKey | LNLXPNFKJYHFJH-UHFFFAOYSA-N |
| Molecular Weight | 168.254 g/mol |
| SMILES | c1(C(C(=O)C)CC)cscc1 |
| SPLASH | splash10-002b-6900000000-87d8d3cf78d1cfbbc8b0 |
| Source of Spectrum | F-35-336-0 |
| Wiley ID | 1164237 |